Molecule

ID:89486

General Information
Structure
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Molecular Formula
C₂H₃ClO
Molecular Mass
78.49762
Exact Mass
77.9872424
Charge
0
InChI
InChI=1S/C2H3ClO/c3-1-2-4/h2H,1H2
InChIKey
QSKPIOLLBIHNAC-UHFFFAOYSA-N
Canonic Smiles
ClCC=O
Isomeric Smiles
O=CCCl
Calculated Properties
JChem
Acid pKa
11.839859
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.15538165
LogD (pH = 7.4)
0.1553661
Log P
0.15538184
Molar Refractivity
16.4715
Polarizability
6.4189663
Polar Surface Area
17.07
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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